ChemSpider 2D Image | 3-(2,3-Dihydro-1-benzofuran-5-yl)-N-[6-(trifluoromethyl)-3-pyridinyl]-1H-pyrazole-5-carboxamide | C18H13F3N4O2

3-(2,3-Dihydro-1-benzofuran-5-yl)-N-[6-(trifluoromethyl)-3-pyridinyl]-1H-pyrazole-5-carboxamide

  • Molecular FormulaC18H13F3N4O2
  • Average mass374.317 Da
  • Monoisotopic mass374.099060 Da
  • ChemSpider ID32513182

More details:






Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1H-Pyrazole-5-carboxamide, 3-(2,3-dihydro-5-benzofuranyl)-N-[6-(trifluoromethyl)-3-pyridinyl]- [ACD/Index Name]
3-(2,3-Dihydro-1-benzofuran-5-yl)-N-[6-(trifluormethyl)-3-pyridinyl]-1H-pyrazol-5-carboxamid [German] [ACD/IUPAC Name]
3-(2,3-Dihydro-1-benzofuran-5-yl)-N-[6-(trifluoromethyl)-3-pyridinyl]-1H-pyrazole-5-carboxamide [ACD/IUPAC Name]
3-(2,3-Dihydro-1-benzofuran-5-yl)-N-[6-(trifluorométhyl)-3-pyridinyl]-1H-pyrazole-5-carboxamide [French] [ACD/IUPAC Name]
3-(2,3-dihydro-1-benzofuran-5-yl)-N-[6-(trifluoromethyl)pyridin-3-yl]-1H-pyrazole-5-carboxamide
5-(2,3-Dihydro-benzofuran-5-yl)-2H-pyrazole-3-carboxylic acid (6-trifluoromethyl-pyridin-3-yl)-amide

    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

    Density: 1.5±0.1 g/cm3
    Boiling Point: 510.4±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 78.1±3.0 kJ/mol
    Flash Point: 262.5±30.1 °C
    Index of Refraction: 1.635
    Molar Refractivity: 90.2±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 2
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 3.42
    ACD/LogD (pH 5.5): 3.10
    ACD/BCF (pH 5.5): 134.51
    ACD/KOC (pH 5.5): 1162.42
    ACD/LogD (pH 7.4): 3.10
    ACD/BCF (pH 7.4): 134.42
    ACD/KOC (pH 7.4): 1161.70
    Polar Surface Area: 80 Å2
    Polarizability: 35.8±0.5 10-24cm3
    Surface Tension: 58.2±3.0 dyne/cm
    Molar Volume: 252.0±3.0 cm3

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